Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8057322 | 0.81 | HTR2A (0.42) | HTTALDH1A1KDM4EHSD17B10HTR2A | |
| SCHEMBL6111396 | 0.79 | NPC1 (0.40) | ALDH1A1KDM4EHSD17B10HTR2ATDP1 | |
| SCHEMBL7539493 | 0.78 | CHRNA7 (0.33) | HSD17B10HTR2ATDP1MAPK1TP53 | |
| SCHEMBL815747 | 0.77 | MEN1 (0.39) | ALDH1A1KDM4EHSD17B10TP53MAPT | |
| SCHEMBL2122339 | 0.75 | MEN1 (0.44) | ALDH1A1KDM4EMAPK1SMN1; SMN2NPC1 | |
| SCHEMBL317685 | 0.73 | LTA4H (0.47) | ALDH1A1KDM4EHSD17B10TDP1TP53 | |
| SCHEMBL635906 | 0.72 | TAAR1 (0.46) | ALDH1A1KDM4EHTR2ATDP1MAPK1 | |
| SCHEMBL790516 | 0.72 | ALDH1A1 (0.46) | ALDH1A1TDP1 | |
| SCHEMBL814450 | 0.72 | LTA4H (0.47) | ALDH1A1TDP1MAPK1TP53 | |
| SCHEMBL8340935 | 0.72 | RELA (0.40) | ALDH1A1KDM4EHSD17B10TP53MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2207773-A2 | HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF | Otsuka Pharmaceutical Co., Ltd. (JP) | 2010-07-21 | — | — | EP | disclosed |
| WO-2009057811-A2 | HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2009-05-07 | — | — | WO | disclosed |